Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ENPP3 | O14638 | 5/20 | 0.39 |
| ▸ | ALPL | P05186 | 5/20 | 0.39 |
| ▸ | XIAP | P98170 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | F12 | P00748 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL753657 | 0.81 | TSHR (0.58) | TSHRENPP3ALPLXIAPALDH1A1 | |
| SCHEMBL2960135 | 0.76 | ALDH1A1 (0.38) | TSHRENPP3ALPLXIAPALDH1A1 | |
| Cyclohexane SCHEMBL8747257 | 0.76 | TSHR (0.53) | TSHRENPP3ALPLXIAPALDH1A1 | |
| Nitrous Acid SCHEMBL14661057 | 0.75 | TSHR (0.51) | TSHRENPP3ALPLXIAPALDH1A1 | |
| SCHEMBL18601423 | 0.68 | ENPP3 (0.47) | TSHRENPP3ALPLXIAPALDH1A1 | |
| SCHEMBL1531077 | 0.68 | KMT2A (0.38) | TSHRALDH1A1L3MBTL1MEN1CYP1A2 | |
| SCHEMBL173200 | 0.66 | — | — | |
| SCHEMBL11312956 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL21981571 | 0.64 | — | — | |
| SCHEMBL29520478 | 0.64 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2006206473-A | METHOD FOR PRODUCING 3-HYDROXYPYRAZOLE-1-CARBOXAMIDE DERIVATIVE | SAGAMI CHEM RES CENTER | 2006-08-10 | — | — | JP | disclosed |